ChemSpider 2D Image | 3H-1,2-Benzodioxol-3-one | C7H4O3

3H-1,2-Benzodioxol-3-one

  • Molecular FormulaC7H4O3
  • Average mass136.105 Da
  • Monoisotopic mass136.016037 Da
  • ChemSpider ID67166984

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3H-1,2-Benzodioxol-3-on [German] [ACD/IUPAC Name]
3H-1,2-Benzodioxol-3-one [ACD/Index Name] [ACD/IUPAC Name]
3H-1,2-Benzodioxol-3-one [French] [ACD/Index Name] [ACD/IUPAC Name]
benzodioxolone

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 215.6±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.2±3.0 kJ/mol
Flash Point: 111.7±16.7 °C
Index of Refraction: 1.585
Molar Refractivity: 32.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 17.17
ACD/KOC (pH 5.5): 266.37
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.17
ACD/KOC (pH 7.4): 266.37
Polar Surface Area: 36 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 97.1±3.0 cm3

Click to predict properties on the Chemicalize site


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